Geometry & MOs

Info

ID:	402733
PubChem CID:	135057045
Reduced:	ClSiO2C10H21 (1)
Stoich.:	ABC2D10E21 (1)
Weight, g/mol:	238.102751
ΔH_f, kcal/mol:	-158.15
Dipole, Da:	1.06
IP(EA), eV:	-8.98(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4R)-4-hydroxy-3-phenylsulfanylheptan-2-one

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OCC[C@@H](C=O)Cl

DOS

IR

Vibrations